2-[6-(3,4-dichlorophenyl)carbonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanenitrile

Systemtic Name: 2-[6-(3,4-dichlorophenyl)carbonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanenitrile Openeye Name: 2-[6-(3,4-dichlorobenzoyl)-2-oxo-1,3-benzoxazol-3-yl]acetonitrile CAS Name: 2-[6-[(3,4-dichlorophenyl)-oxomethyl]-2-oxo-1,3-benzoxazol-3-yl]acetonitrile IUPAC Name: 2-[6-(3,4-dichlorobenzoyl)-2-oxo-1,3-benzoxazol-3-yl]acetonitrile Traditional Name: 2-[6-(3,4-dichlorobenzoyl)-2-keto-1,3-benzoxazol-3-yl]acetonitrile Formula: C16H8Cl2N2O3 MolecularWeight: 347.15232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)C3=CC(=C(C=C3)Cl)Cl)OC(=O)N2CC#N

Isomeric SMILES

C1=CC2=C(C=C1C(=O)C3=CC(=C(C=C3)Cl)Cl)OC(=O)N2CC#N

InChI

InChI=1S/C16H8Cl2N2O3/c17-11-3-1-9(7-12(11)18)15(21)10-2-4-13-14(8-10)23-16(22)20(13)6-5-19/h1-4,7-8H,6H2